8-amino-7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-4-ol

C11H16N2O2 — CID 82395337

IUPAC8-amino-7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-4-ol
SMILESCOc1ccc2c(c1N)CN(C)CC2O
InChIInChI=1S/C11H16N2O2/c1-13-5-8-7(9(14)6-13)3-4-10(15-2)11(8)12/h3-4,9,14H,5-6,12H2,1-2H3
InChIKeyACVPKCYNTZJVTN-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.76
Rot. Bonds1

About 8-amino-7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-4-ol

8-amino-7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-4-ol (PubChem CID 82395337) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 8-amino-7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-4-ol.

Molecular Properties

Compound Name8-amino-7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-4-ol
PubChem CID82395337
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name8-amino-7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-4-ol
SMILESCOc1ccc2c(c1N)CN(C)CC2O
InChIInChI=1S/C11H16N2O2/c1-13-5-8-7(9(14)6-13)3-4-10(15-2)11(8)12/h3-4,9,14H,5-6,12H2,1-2H3
InChIKeyACVPKCYNTZJVTN-UHFFFAOYSA-N
XLogP0.76
TPSA58.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

7-methoxy-2,8-dimethyl-3,4-dihydro-1H-isoquinolin-4-ol
CID 121000209
7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-8-amine
CID 84664224
7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-4-ol;hydrochloride
CID 162061488
5-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-4-ol
CID 122504635
(8-hydroxy-7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-4-yl) acetate
CID 13185069
8-amino-5-bromo-2-methyl-3,4-dihydro-1H-isoquinolin-4-ol
CID 82380521
1,2-dimethoxy-5,6,7,8,9,10,11,12-octahydrobenzo[10]annulen-5-ol
CID 23730575
2,6-dimethoxyaniline;ethane
CID 145233133
8-methoxy-3,4-dihydro-1H-isothiochromen-4-ol
CID 82887429
1-(3,4-dimethoxyphenyl)sulfonyl-2,3-dihydroindol-3-ol
CID 19009089
(4-aminophenyl)-(4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone;hydrochloride
CID 119694107
2,3-diamino-4-methoxyphenol
CID 70465216

Frequently Asked Questions

What is the IUPAC name of 8-amino-7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-4-ol?
The IUPAC name of 8-amino-7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-4-ol (CID 82395337) is 8-amino-7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-4-ol.
What is the SMILES notation for 8-amino-7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-4-ol?
The canonical SMILES for 8-amino-7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-4-ol is COc1ccc2c(c1N)CN(C)CC2O.
What is the InChIKey of 8-amino-7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-4-ol?
The InChIKey is ACVPKCYNTZJVTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-13-5-8-7(9(14)6-13)3-4-10(15-2)11(8)12/h3-4,9,14H,5-6,12H2,1-2H3.
What are the key properties of 8-amino-7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-4-ol?
8-amino-7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-4-ol has a molecular weight of 208.26 g/mol, XLogP of 0.76, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-amino-7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-4-ol is sourced from PubChem (CID 82395337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).